9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one

C88H120N8O16 — CID 159613285

IUPAC9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one
SMILESC=C(C)C(=O)N1C(=O)C2CCCC21.C=C(C)C(=O)N1C(=O)C2CCCCC21.C=C(C)C(=O)N1C(=O)C2CCCCCC21.C=C(C)C(=O)N1C(=O)C2CCCCCCC21.C=CC(=O)N1C(=O)C2CCCC21.C=CC(=O)N1C(=O)C2CCCCC21.C=CC(=O)N1C(=O)C2CCCCCC21.C=CC(=O)N1C(=O)C2CCCCCCC21
InChIInChI=1S/C13H19NO2.2C12H17NO2.2C11H15NO2.2C10H13NO2.C9H11NO2/c1-9(2)12(15)14-11-8-6-4-3-5-7-10(11)13(14)16;1-8(2)11(14)13-10-7-5-3-4-6-9(10)12(13)15;1-2-11(14)13-10-8-6-4-3-5-7-9(10)12(13)15;1-7(2)10(13)12-9-6-4-3-5-8(9)11(12)14;1-2-10(13)12-9-7-5-3-4-6-8(9)11(12)14;1-6(2)9(12)11-8-5-3-4-7(8)10(11)13;1-2-9(12)11-8-6-4-3-5-7(8)10(11)13;1-2-8(11)10-7-5-3-4-6(7)9(10)12/h10-11H,1,3-8H2,2H3;9-10H,1,3-7H2,2H3;2,9-10H,1,3-8H2;8-9H,1,3-6H2,2H3;2,8-9H,1,3-7H2;7-8H,1,3-5H2,2H3;2,7-8H,1,3-6H2;2,6-7H,1,3-5H2
InChIKeyMMYZUVKZYKDUKS-UHFFFAOYSA-N
MW1545.97 g/mol
LogP11.92
Rot. Bonds8

About 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one

9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one (PubChem CID 159613285) has the molecular formula C88H120N8O16 and a molecular weight of 1545.97 g/mol. Its IUPAC name is 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one.

Molecular Properties

Compound Name9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one
PubChem CID159613285
Molecular FormulaC88H120N8O16
Molecular Weight1545.97 g/mol
Exact Mass1544.88
IUPAC Name9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one
SMILESC=C(C)C(=O)N1C(=O)C2CCCC21.C=C(C)C(=O)N1C(=O)C2CCCCC21.C=C(C)C(=O)N1C(=O)C2CCCCCC21.C=C(C)C(=O)N1C(=O)C2CCCCCCC21.C=CC(=O)N1C(=O)C2CCCC21.C=CC(=O)N1C(=O)C2CCCCC21.C=CC(=O)N1C(=O)C2CCCCCC21.C=CC(=O)N1C(=O)C2CCCCCCC21
InChIInChI=1S/C13H19NO2.2C12H17NO2.2C11H15NO2.2C10H13NO2.C9H11NO2/c1-9(2)12(15)14-11-8-6-4-3-5-7-10(11)13(14)16;1-8(2)11(14)13-10-7-5-3-4-6-9(10)12(13)15;1-2-11(14)13-10-8-6-4-3-5-7-9(10)12(13)15;1-7(2)10(13)12-9-6-4-3-5-8(9)11(12)14;1-2-10(13)12-9-7-5-3-4-6-8(9)11(12)14;1-6(2)9(12)11-8-5-3-4-7(8)10(11)13;1-2-9(12)11-8-6-4-3-5-7(8)10(11)13;1-2-8(11)10-7-5-3-4-6(7)9(10)12/h10-11H,1,3-8H2,2H3;9-10H,1,3-7H2,2H3;2,9-10H,1,3-8H2;8-9H,1,3-6H2,2H3;2,8-9H,1,3-7H2;7-8H,1,3-5H2,2H3;2,7-8H,1,3-6H2;2,6-7H,1,3-5H2
InChIKeyMMYZUVKZYKDUKS-UHFFFAOYSA-N
XLogP11.92
TPSA299.04 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds8
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001545.97
LogP ≤ 511.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one with MolForge

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Related Compounds

6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one
CID 58165399
[3-oxo-3-(9-oxo-8-azabicyclo[5.2.0]nonan-8-yl)propyl] 2-methylprop-2-enoate
CID 67963825
6-prop-2-enoyl-3-oxa-6-azabicyclo[3.2.0]heptan-7-one
CID 67963785
2-(2-methylprop-2-enoyl)-5,6,7,8,9,10,11,11a-octahydro-3aH-cyclodeca[c]pyrrole-1,3,4-trione
CID 66678473
6-[(1S)-2,3,4-trimethylcyclobut-2-ene-1-carbonyl]-6-azabicyclo[3.2.0]heptan-7-one
CID 88869524
[1-oxo-1-(8-oxo-7-azabicyclo[4.2.0]octan-7-yl)propan-2-yl] 2,2-dimethylbutanoate
CID 67963872
1-prop-2-enoyl-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-5-one
CID 103195064
(3aS,6aR)-2-methyl-5-prop-2-enoyl-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-1,3-dione
CID 136588917
1-[(2S)-2-ethenylpyrrolidin-1-yl]-2-methylprop-2-en-1-one
CID 102330307
(3R,5S)-3,5-bis(ethenyl)-1-prop-2-enoylpyrrolidin-2-one
CID 102474509
2-[(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)oxy]butan-2-yl prop-2-enoate
CID 67622892
(5-oxo-4-prop-2-enoyl-4-azatetracyclo[7.2.1.02,8.03,6]dodecan-10-yl) acetate
CID 58165611

Frequently Asked Questions

What is the IUPAC name of 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one?
The IUPAC name of 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one (CID 159613285) is 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one.
What is the SMILES notation for 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one?
The canonical SMILES for 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one is C=C(C)C(=O)N1C(=O)C2CCCC21.C=C(C)C(=O)N1C(=O)C2CCCCC21.C=C(C)C(=O)N1C(=O)C2CCCCCC21.C=C(C)C(=O)N1C(=O)C2CCCCCCC21.C=CC(=O)N1C(=O)C2CCCC21.C=CC(=O)N1C(=O)C2CCCCC21.C=CC(=O)N1C(=O)C2CCCCCC21.C=CC(=O)N1C(=O)C2CCCCCCC21.
What is the InChIKey of 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one?
The InChIKey is MMYZUVKZYKDUKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2.2C12H17NO2.2C11H15NO2.2C10H13NO2.C9H11NO2/c1-9(2)12(15)14-11-8-6-4-3-5-7-10(11)13(14)16;1-8(2)11(14)13-10-7-5-3-4-6-9(10)12(13)15;1-2-11(14)13-10-8-6-4-3-5-7-9(10)12(13)15;1-7(2)10(13)12-9-6-4-3-5-8(9)11(12)14;1-2-10(13)12-9-7-5-3-4-6-8(9)11(12)14;1-6(2)9(12)11-8-5-3-4-7(8)10(11)13;1-2-9(12)11-8-6-4-3-5-7(8)10(11)13;1-2-8(11)10-7-5-3-4-6(7)9(10)12/h10-11H,1,3-8H2,2H3;9-10H,1,3-7H2,2H3;2,9-10H,1,3-8H2;8-9H,1,3-6H2,2H3;2,8-9H,1,3-7H2;7-8H,1,3-5H2,2H3;2,7-8H,1,3-6H2;2,6-7H,1,3-5H2.
What are the key properties of 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one?
9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one has a molecular weight of 1545.97 g/mol, XLogP of 11.92, 8 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methylprop-2-enoyl)-9-azabicyclo[6.2.0]decan-10-one;6-(2-methylprop-2-enoyl)-6-azabicyclo[3.2.0]heptan-7-one;8-(2-methylprop-2-enoyl)-8-azabicyclo[5.2.0]nonan-9-one;7-(2-methylprop-2-enoyl)-7-azabicyclo[4.2.0]octan-8-one;9-prop-2-enoyl-9-azabicyclo[6.2.0]decan-10-one;6-prop-2-enoyl-6-azabicyclo[3.2.0]heptan-7-one;8-prop-2-enoyl-8-azabicyclo[5.2.0]nonan-9-one;7-prop-2-enoyl-7-azabicyclo[4.2.0]octan-8-one is sourced from PubChem (CID 159613285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).